1-[3-[methyl-(phenylmethyl)amino]piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[3-[methyl-(phenylmethyl)amino]piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[3-[benzyl(methyl)amino]-1-piperidyl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[3-[methyl-(phenylmethyl)amino]-1-piperidinyl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[3-[benzyl(methyl)amino]piperidin-1-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-[3-[benzyl(methyl)amino]piperidino]-2-(4-pyridylthio)ethanone Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2CCCN(C2)C(=O)CSC3=CC=NC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)C2CCCN(C2)C(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C20H25N3OS/c1-22(14-17-6-3-2-4-7-17)18-8-5-13-23(15-18)20(24)16-25-19-9-11-21-12-10-19/h2-4,6-7,9-12,18H,5,8,13-16H2,1H3